SCHEMBL27228349

SCHEMBL27228349

Cc1ccc2c(n1)C(C)(C)CN2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRKAA2 P54646 1/20 0.51
▸ MCHR1 Q99705 7/20 0.49
▸ SIGMAR1 Q99720 7/20 0.48
▸ CCR3 P51677 6/20 0.47
▸ SLC6A12 P48065 1/20 0.45
▸ TMEM97 Q5BJF2 1/20 0.45
▸ CYP2D6 P10635 2/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ DRD3 P35462 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27228677 0.91 DPP7 (0.51) SIGMAR1SLC6A12DRD3
SCHEMBL27228601 0.90 SIGMAR1 (0.50) MCHR1SIGMAR1CCR3HTR2A
SCHEMBL31016697 0.90 SIGMAR1 (0.50) MCHR1SIGMAR1CCR3HTR2A
SCHEMBL27228675 0.89 SIGMAR1 (0.52) MCHR1SIGMAR1CCR3CHRM1
SCHEMBL31016658 0.89 SIGMAR1 (0.52) MCHR1SIGMAR1CCR3CHRM1
SCHEMBL27228579 0.88 PRKAA2 (0.53) PRKAA2MCHR1
SCHEMBL27228319 0.87 PRKAA2 (0.51) PRKAA2MCHR1SIGMAR1CCR3SLC6A12
SCHEMBL27228648 0.86 DRD4 (0.48) MCHR1SIGMAR1CCR3
SCHEMBL27228653 0.86 DRD4 (0.48) MCHR1SIGMAR1CCR3
SCHEMBL27232294 0.86 DRD4 (0.48) MCHR1SIGMAR1CCR3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174671-A1 New 2,3-Dihydro-1H-pyrrolo[3,2-b]pyridine Derivatives as Sigma Ligands ACONDICIONAMIENTO TARRASENSE (ES) 2024-05-30 — — US claimed
US-20240174671-A1 New 2,3-Dihydro-1H-pyrrolo[3,2-b]pyridine Derivatives as Sigma Ligands ACONDICIONAMIENTO TARRASENSE (ES) 2024-05-30 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240174671-A1 New 2,3-Dihydro-1H-pyrrolo[3,2-b]pyridine Derivatives as Sigma Ligands SIGMAR1, OPRD1, TMEM97 PRKAA2 780/4885MCHR1 203/4885SIGMAR1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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